tert-butyl N-[(2R)-3-(1H-indol-3-yl)-1-(methylamino)-1-sulfanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-3-(1H-indol-3-yl)-1-(methylamino)-1-sulfanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-1-(1H-indol-3-ylmethyl)-2-(methylamino)-2-thioxo-ethyl]carbamate CAS Name: N-[(2R)-3-(1H-indol-3-yl)-1-(methylamino)-1-sulfanylidenepropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-3-(1H-indol-3-yl)-1-(methylamino)-1-sulfanylidenepropan-2-yl]carbamate Traditional Name: N-[(1R)-1-(1H-indol-3-ylmethyl)-2-(methylamino)-2-thioxo-ethyl]carbamic acid tert-butyl ester Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C(=S)NC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CC1=CNC2=CC=CC=C21)C(=S)NC

InChI

InChI=1S/C17H23N3O2S/c1-17(2,3)22-16(21)20-14(15(23)18-4)9-11-10-19-13-8-6-5-7-12(11)13/h5-8,10,14,19H,9H2,1-4H3,(H,18,23)(H,20,21)/t14-/m1/s1